N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-N-naphthalen-1-yl-adamantane-1-carboxamide

Systemtic Name: N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-N-naphthalen-1-yl-adamantane-1-carboxamide Openeye Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-N-(1-naphthyl)adamantane-1-carboxamide CAS Name: N-[3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propyl]-N-(1-naphthalenyl)-1-adamantanecarboxamide IUPAC Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-N-naphthalen-1-yladamantane-1-carboxamide Traditional Name: N-[3-(1,3-diketobenzo[de]isoquinolin-2-yl)propyl]-N-(1-naphthyl)adamantane-1-carboxamide Formula: C36H34N2O3 MolecularWeight: 542.66676

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N(CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O)C7=CC=CC8=CC=CC=C87

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N(CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O)C7=CC=CC8=CC=CC=C87

InChI

InChI=1S/C36H34N2O3/c39-33-29-12-3-9-27-10-4-13-30(32(27)29)34(40)38(33)16-6-15-37(31-14-5-8-26-7-1-2-11-28(26)31)35(41)36-20-23-17-24(21-36)19-25(18-23)22-36/h1-5,7-14,23-25H,6,15-22H2